HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
2-Bromanilin
O-BROMOANILINE · 2-Bromoanilines · 2-bromobenzenamine · 1-Amino-2-bromobenzene · 2-BromoaniL · 2-BROMOANILINE · BROMOANILINE(2-) · Aniline, o-bromo-
Identifikatoren & physikalische Daten
| CAS No. | 615-36-1 |
|---|---|
| Summenformel | C6H6BrN |
| Durchschnittliche Molmasse | 172,02 g/mol |
| Monoisotopische Masse | 170,96836129 g/mol |
| SMILES | Nc1ccccc1Br |
| InChIKey | AOPBDRUWRLBSDB-UHFFFAOYSA-N |
| PubChem CID | 11992 |
| EC No. | 210-421-3 |
| DTXSID | DTXSID5060645 |
| Lokaler Name | 2-Bromanilin |
Chemische & physikalische Eigenschaften
| XLogP | 2,1 |
|---|---|
| Polarare Oberfläche (TPSA) | 26 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 1 |
| Frei drehbare Bindungen | 0 |
| Schwere Atome | 8 |
| Formalladung | 0 |
| Komplexität | 74,9 |
| Stoffklassen | Nitrogen Compounds -> Amines, Aromatic |
| SpringerMaterials Properties | 15N nuclear magnetic resonance spectrum |
| Dampfdruck | 0.04 [mmHg] |
| Physical Description | Brown solidmp = 27-32 deg C[Alfa Aesar MSDS] |
| Schmelzpunkt | 24-28 °C (lit.) |
| Siedepunkt | 229 °C (lit.) |
| Dichte | 1.52 g/mL at 25 °C (lit.) |
| Brechungsindex | 1.617-1.619 |
| Flammpunkt | >230 °F |
| Lagerbedingungen | 2-8°C |
| Löslichkeit | 0.949g/lInsoluble in water. |
| Aggregatzustand | Liquid After Melting |
| pKa (Säurekonstante) | 2.53(at 25℃) |
| Farbe | Clear yellow to red-brown |
| BRN | 742062 |
| InChI | 1S/C6H6BrN/c7-5-3-1-2-4-6(5)8/h1-4H,8H2 |
| InChIKey | AOPBDRUWRLBSDB-UHFFFAOYSA-N |
| SMILES | Nc1ccccc1Br |
| CAS Datenbank | 615-36-1(CAS DataBase Reference) |
| NIST chemische Informationen | Benzenamine, 2-bromo-(615-36-1) |
| EPA chemische Informationen | Benzenamine, 2-bromo- (615-36-1) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH302 (96.2%): Harmful if swallowed [Warning Acute toxicity, oral]P260, P262, P264, P270, P273, P280, P301+P317, P302+P352, P316, P319, P321, P330, P361+P364, P391, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 53 reports by companies from 12 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Regulatorische Informationen | Chemical: Benzenamine, 2-bromo-Status: Active Update: 03-07-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/233612-Bromoaniline: Does not have an individual approval but may be used under an appropriate group standard |
| Gefahrenübersicht | A skin and strong eye irritantMay induce methemoglobinemiaHarmful by ingestion and inhalationToxic by skin absorptionProlonged or repeated exposure may cause organ injury[Alfa Aesar MSDS] |
| Hazard Classes and Categories | Acute Tox. 4 (96.2%) |
| Unerwünschte Wirkungen | Methemoglobinemia - The presence of increased methemoglobin in the bloodthe compound is classified as secondary toxic effect |
| F | 8-23 |
| Wassergefährdungsklasse (WGK) | 3 |
| TSCA-Inventar-Status | TSCA listed |
| UN-Transportnummer | UN 2811 6.1/PG 3 |
| Zollcode | 29214210 |
| R-Sätze (R) | 23/24/25-33-52/53-36/37/38-20/21/22-24/25 |
| Gefahrensymbole | T,Xn |
| hazard_note | Toxic |
| Sicherheitshinweise (S) | 36/37-45-61-36/37/39-26 |
| Gefahrenklasse | 6.1Acute Tox. 4 DermalAcute Tox. 4 InhalationAcute Tox. 4 OralAquatic Acute 1Aquatic Chronic 1STOT RE 2 |
| Verpackungsgruppe | III |
| Lagerklasse | 10 - Combustible liquids |
Anwendungen & Verwendung
Verwenden
2-Bromoaniline is used as a corrosion inhibitor, emulsifying and antiseptic agents. It is used in the rubber industry, e.g. diphenylguanidines, phenylenediamines mercaptobenzothiazoles, aniline ketones and etc.